diethyl 2-[2-[3-acetyloxy-3-(furan-2-yl)prop-1-ynyl]phenyl]propanedioate

Systemtic Name: diethyl 2-[2-[3-acetyloxy-3-(furan-2-yl)prop-1-ynyl]phenyl]propanedioate Openeye Name: diethyl 2-[2-[3-acetoxy-3-(2-furyl)prop-1-ynyl]phenyl]propanedioate CAS Name: 2-[2-[3-acetyloxy-3-(2-furanyl)prop-1-ynyl]phenyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[2-[3-acetyloxy-3-(furan-2-yl)prop-1-ynyl]phenyl]propanedioate Traditional Name: 2-[2-[3-acetoxy-3-(2-furyl)prop-1-ynyl]phenyl]malonic acid diethyl ester Formula: C22H22O7 MolecularWeight: 398.40588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=CC=C1C#CC(C2=CC=CO2)OC(=O)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C1=CC=CC=C1C#CC(C2=CC=CO2)OC(=O)C)C(=O)OCC

InChI

InChI=1S/C22H22O7/c1-4-26-21(24)20(22(25)27-5-2)17-10-7-6-9-16(17)12-13-19(29-15(3)23)18-11-8-14-28-18/h6-11,14,19-20H,4-5H2,1-3H3